bis[7-(4-butylphenyl)-2-hexyl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride

Systemtic Name: bis[7-(4-butylphenyl)-2-hexyl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Openeye Name: bis[7-(4-butylphenyl)-2-hexyl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride CAS Name: bis[7-(4-butylphenyl)-2-hexyl-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(4+); dichloride IUPAC Name: bis[7-(4-butylphenyl)-2-hexyl-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(4+); dichloride Traditional Name: bis[7-(4-butylphenyl)-2-hexyl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Formula: C52H66Cl2SiZr MolecularWeight: 881.29594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)CCCC)[Si](C)(C)C4=C([CH-]C5=C4C(=CC=C5)C6=CC=C(C=C6)CCCC)CCCCCC.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCCCCCC1=C(C2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)CCCC)[Si](C)(C)C4=C([CH-]C5=C4C(=CC=C5)C6=CC=C(C=C6)CCCC)CCCCCC.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C52H66Si.2ClH.Zr/c1-7-11-15-17-23-45-37-43-25-19-27-47(41-33-29-39(30-34-41)21-13-9-3)49(43)51(45)53(5,6)52-46(24-18-16-12-8-2)38-44-26-20-28-48(50(44)52)42-35-31-40(32-36-42)22-14-10-4;;;/h19-20,25-38H,7-18,21-24H2,1-6H3;2*1H;/q-2;;;+4/p-2